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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02234778

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MUDN-{[(1R)-1-carboxy-2-(methylsulfanyl)ethyl]carbamoyl}-
L-glutamic acid
A3D7G0.7
AS1ARGININOSUCCINATEA,B,C,D1TJW0.72
AS1ARGININOSUCCINATED1DCN0.72
AS1ARGININOSUCCINATEA,B,C,D1K7W0.72
AS1ARGININOSUCCINATEA,B,C,D1J200.72
MEQN5-METHYLGLUTAMINEA,B1NV80.71
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B1O5K0.71
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B3CPR0.71
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B2VC60.71
GVA5-{[AMINO(IMINO)METHYL]AMINO}PENTANOIC ACIDA,B,C,D2IHV0.71
AAGN-ALPHA-L-ACETYL-ARGININEA1DRY0.71
SMZN~5~-[(E)-imino(methylsulfanyl)methyl]-
L-ornithine
A,B3BPB0.72
DGLD-GLUTAMIC ACIDA,B2JFX0.77
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5D0.77
DGLD-GLUTAMIC ACIDA1C4B0.77
DGLD-GLUTAMIC ACIDA1CW80.77
DGLD-GLUTAMIC ACIDA,D1CZQ0.77
DGLD-GLUTAMIC ACIDA,B2JFY0.77
DGLD-GLUTAMIC ACIDI1QUR0.77
DGLD-GLUTAMIC ACIDA,D2Q3I0.77
DGLD-GLUTAMIC ACIDA1CVQ0.77
DGLD-GLUTAMIC ACIDA,B1P4N0.77
DGLD-GLUTAMIC ACIDA,B2VVT0.77
DGLD-GLUTAMIC ACIDE,S148L0.77
DGLD-GLUTAMIC ACIDA1KR60.77
DGLD-GLUTAMIC ACIDA,B,C,D2GZM0.77
DGLD-GLUTAMIC ACIDA1AY30.77
DGLD-GLUTAMIC ACIDA2J8F0.77
DGLD-GLUTAMIC ACIDU2AIZ0.77
DGLD-GLUTAMIC ACIDA,B,C2DWU0.77
DGLD-GLUTAMIC ACIDL2EAX0.77
DGLD-GLUTAMIC ACIDA,B2JFZ0.77
DGLD-GLUTAMIC ACIDH,I4THN0.77
DGLD-GLUTAMIC ACIDA1CWZ0.77
DGLD-GLUTAMIC ACIDP1MCK0.77
DGLD-GLUTAMIC ACIDA2JUE0.77
DGLD-GLUTAMIC ACIDA,B2JFO0.77
DGLD-GLUTAMIC ACIDA3H410.77
DGLD-GLUTAMIC ACIDA1D0K0.77
DGLD-GLUTAMIC ACIDL,N1WCO0.77
DGLD-GLUTAMIC ACIDA,B,C1ZUW0.77
DGLD-GLUTAMIC ACIDH,I5GDS0.77
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5B0.77
DGLD-GLUTAMIC ACIDA,B2JFQ0.77
DGLD-GLUTAMIC ACIDA,B2Q330.77
DGLD-GLUTAMIC ACIDA,B2JFP0.77
DGLD-GLUTAMIC ACIDA,B,E,F2W4I0.77
DGLD-GLUTAMIC ACIDA2J8G0.77
DGLD-GLUTAMIC ACIDA,B,C,D2R3C0.77
LME(3R)-3-METHYL-L-GLUTAMIC ACIDA1XT70.71
ILON5-IMINOETHYL-L-ORNITHINEA,B1ED60.74
IMLN-METHYL-ISOLEUCINEC1CWM0.71
DA2NG,NG-DIMETHYL-L-ARGININEA,C,P,R2VPG0.71
DA2NG,NG-DIMETHYL-L-ARGININEA,B7NSE0.71
DA2NG,NG-DIMETHYL-L-ARGININEA,B,D,E2V860.71
DA2NG,NG-DIMETHYL-L-ARGININED2B2U0.71
SUGN~2~-(3-CARBOXYPROPANOYL)-L-ARGININEA,B,C,D1YNI0.74
SUGN~2~-(3-CARBOXYPROPANOYL)-L-ARGININEA2P8C0.74
MEG(2S,3R)-3-METHYL-GLUTAMIC ACIDA1T5N0.71
MEG(2S,3R)-3-METHYL-GLUTAMIC ACIDA1T5M0.71
IELN~6~-[(1Z)-ethanimidoyl]-L-lysineA3DIR0.72
NMM(R)-2-AMINO-5-(3-METHYLGUANIDINO)BUTANOIC ACIDA,B,D,E2V850.73
NNHNOR-N-OMEGA-HYDROXY-L-ARGININEA,B,C1HQH0.76
3ARN-OMEGA-PROPYL-L-ARGININEA1QW60.72
3ARN-OMEGA-PROPYL-L-ARGININEA,B1QW40.72
3ARN-OMEGA-PROPYL-L-ARGININEA,B1MMV0.72
CMAN2-(CARBOXYETHYL)-L-ARGININEA,B1JGT0.75
DARD-ARGININEA,B2Q330.76
DARD-ARGININEA,B,E,F,G,H1MHW0.76
DARD-ARGININEA2JUE0.76
DARD-ARGININEH,I1A4W0.76
DARD-ARGININEA1BDK0.76
DARD-ARGININEA1CWZ0.76
DARD-ARGININEB1CFA0.76
DARD-ARGININEB,C3BV90.76
DARD-ARGININEA1CVQ0.76
DARD-ARGININEA1P520.76
DARD-ARGININEA,D1CZQ0.76
DARD-ARGININEA1CW80.76
DARD-ARGININEA,B,C,D3BOG0.76
DARD-ARGININEA1BFW0.76
DARD-ARGININEA1BG00.76
HMRBETA-HOMOARGININEI1ABI0.7
HMRBETA-HOMOARGININER1NRQ0.7
HMRBETA-HOMOARGININER1NRP0.7
HMRBETA-HOMOARGININEA3C3G0.7
HMRBETA-HOMOARGININEA3C3H0.7
HRGL-HOMOARGININEA,B,C2VDN0.75
HRGL-HOMOARGININEA3DIQ0.75
HRGL-HOMOARGININEA,B1DM70.75
VION5-(1-IMINO-3-BUTENYL)-L-ORNITHINEA,B1MMW0.71
NLGN-ACETYL-L-GLUTAMATEA1OH90.79
NLGN-ACETYL-L-GLUTAMATEA1OHA0.79
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,I,J,K,L
2BUF0.79
NLGN-ACETYL-L-GLUTAMATEA,B,C,D2RD50.79
NLGN-ACETYL-L-GLUTAMATEA,B2JJ40.79
NLGN-ACETYL-L-GLUTAMATEA,B,C,D,E,F,
G,H,J,K
2V5H0.79
NLGN-ACETYL-L-GLUTAMATEA1GSJ0.79
NLGN-ACETYL-L-GLUTAMATEA3B8G0.79
NLGN-ACETYL-L-GLUTAMATEA1GS50.79
NLGN-ACETYL-L-GLUTAMATEA,B,C2BTY0.79
SYM2S,4R-4-METHYLGLUTAMATEA,B1SD30.71
DNMN-METHYL-D-NORLEUCINEA,B1S1O0.71
DNMN-METHYL-D-NORLEUCINEA,B1S4A0.71
DNMN-METHYL-D-NORLEUCINEA1R9V0.71
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D2GGH0.74
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D1XPY0.74
HARN-OMEGA-HYDROXY-L-ARGININEX2FBZ0.74
HARN-OMEGA-HYDROXY-L-ARGININEA,B1DWW0.74
HARN-OMEGA-HYDROXY-L-ARGININEA,B3NOS0.74
HARN-OMEGA-HYDROXY-L-ARGININEA,B1DWV0.74
HARN-OMEGA-HYDROXY-L-ARGININEA,B1DWX0.74
HARN-OMEGA-HYDROXY-L-ARGININEA,B5NSE0.74
HARN-OMEGA-HYDROXY-L-ARGININEA,B2FC20.74
HARN-OMEGA-HYDROXY-L-ARGININEA1M7Z0.74
HARN-OMEGA-HYDROXY-L-ARGININEA,B,C1HQF0.74
HARN-OMEGA-HYDROXY-L-ARGININEA,B1LZX0.74
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G650.71
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6A0.71
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G680.71
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG70.71
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6C0.71
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG60.71
GND2-AMINO-5-GUANIDINO-PENTANOIC ACIDA1NBK0.76
NIGN-(IMINOMETHYL)-L-GLUTAMIC ACIDA,B2PUZ1
MLEN-METHYLLEUCINEA,D2J9A0.71
MLEN-METHYLLEUCINEC1IKF0.71
MLEN-METHYLLEUCINEA,M,N2Z6W0.71
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P
1C5F0.71
MLEN-METHYLLEUCINED,E,F1XQ70.71
MLEN-METHYLLEUCINEC1CWA0.71
MLEN-METHYLLEUCINEC1CWF0.71
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P,R,T
2RMB0.71
MLEN-METHYLLEUCINEB3CYS0.71
MLEN-METHYLLEUCINEC1CWH0.71
MLEN-METHYLLEUCINEA,B,C,D,E,F,
G,H
3BO70.71
MLEN-METHYLLEUCINEC1CYN0.71
MLEN-METHYLLEUCINEA1LV90.71
MLEN-METHYLLEUCINEC,D2OJU0.71
MLEN-METHYLLEUCINEB,D,F,H,J,L,
N,P,R,T
2RMA0.71
MLEN-METHYLLEUCINEA1IKM0.71
MLEN-METHYLLEUCINEC1CWK0.71
MLEN-METHYLLEUCINEA,B2HG80.71
MLEN-METHYLLEUCINEC1CWB0.71
MLEN-METHYLLEUCINEC1CWJ0.71
MLEN-METHYLLEUCINEA1CYB0.71
MLEN-METHYLLEUCINED1QNG0.71
MLEN-METHYLLEUCINEB1MIK0.71
MLEN-METHYLLEUCINEA1CSA0.71
MLEN-METHYLLEUCINEC1CWL0.71
MLEN-METHYLLEUCINEA1CYA0.71
MLEN-METHYLLEUCINEA,B,D1MF80.71
MLEN-METHYLLEUCINEC1BCK0.71
MLEN-METHYLLEUCINEA,B,D,E,F,H1M630.71
MLEN-METHYLLEUCINEC1CWC0.71
MLEN-METHYLLEUCINEC1CWI0.71
MLEN-METHYLLEUCINEC,D1QNH0.71
MLEN-METHYLLEUCINEB,D,F,H2RMC0.71
MLEN-METHYLLEUCINEC1CWM0.71
MLEN-METHYLLEUCINET,U,V2POY0.71
MLEN-METHYLLEUCINEA,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.71
MLEN-METHYLLEUCINEC1CWO0.71
MLEN-METHYLLEUCINEA1IKL0.71
SHRN-(5-AMINO-5-CARBOXYPENTYL)GLUTAMIC ACIDA,B,C,D,E,F,
G,H
1E5Q0.79
MMON~5~-(DIAMINOMETHYLENE)-N~2~-METHYLORNITHINEA1EB10.74